(2R,3S)-N-(5-cyclopentyl-1-methyl-2-oxidanylidene-3H-1,4-benzodiazepin-3-yl)-2-(cyclopropylmethyl)-3-oxidanyl-heptanamide

Systemtic Name: (2R,3S)-N-(5-cyclopentyl-1-methyl-2-oxidanylidene-3H-1,4-benzodiazepin-3-yl)-2-(cyclopropylmethyl)-3-oxidanyl-heptanamide Openeye Name: (2R,3S)-N-(5-cyclopentyl-1-methyl-2-oxo-3H-1,4-benzodiazepin-3-yl)-2-(cyclopropylmethyl)-3-hydroxy-heptanamide CAS Name: (2R,3S)-N-(5-cyclopentyl-1-methyl-2-oxo-3H-1,4-benzodiazepin-3-yl)-2-(cyclopropylmethyl)-3-hydroxyheptanamide IUPAC Name: (2R,3S)-N-(5-cyclopentyl-1-methyl-2-oxo-3H-1,4-benzodiazepin-3-yl)-2-(cyclopropylmethyl)-3-hydroxyheptanamide Traditional Name: (2R,3S)-N-(5-cyclopentyl-2-keto-1-methyl-3H-1,4-benzodiazepin-3-yl)-2-(cyclopropylmethyl)-3-hydroxy-enanthamide Formula: C26H37N3O3 MolecularWeight: 439.59028

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(CC1CC1)C(=O)NC2C(=O)N(C3=CC=CC=C3C(=N2)C4CCCC4)C)O

Isomeric SMILES

CCCC[C@@H]([C@@H](CC1CC1)C(=O)NC2C(=O)N(C3=CC=CC=C3C(=N2)C4CCCC4)C)O

InChI

InChI=1S/C26H37N3O3/c1-3-4-13-22(30)20(16-17-14-15-17)25(31)28-24-26(32)29(2)21-12-8-7-11-19(21)23(27-24)18-9-5-6-10-18/h7-8,11-12,17-18,20,22,24,30H,3-6,9-10,13-16H2,1-2H3,(H,28,31)/t20-,22+,24?/m1/s1